(2R)-1-[(3-methylphenyl)methyl-(2-morpholin-4-ylethyl)amino]-3-phenylpropan-2-ol

C23H32N2O2 — CID 93162213

IUPAC(2R)-1-[(3-methylphenyl)methyl-(2-morpholin-4-ylethyl)amino]-3-phenylpropan-2-ol
SMILESCc1cccc(CN(CCN2CCOCC2)C[C@H](O)Cc2ccccc2)c1
InChIInChI=1S/C23H32N2O2/c1-20-6-5-9-22(16-20)18-25(11-10-24-12-14-27-15-13-24)19-23(26)17-21-7-3-2-4-8-21/h2-9,16,23,26H,10-15,17-19H2,1H3/t23-/m1/s1
InChIKeyPYUYQKYFMACHSX-HSZRJFAPSA-N
MW368.52 g/mol
LogP2.73
Rot. Bonds9

About (2R)-1-[(3-methylphenyl)methyl-(2-morpholin-4-ylethyl)amino]-3-phenylpropan-2-ol

(2R)-1-[(3-methylphenyl)methyl-(2-morpholin-4-ylethyl)amino]-3-phenylpropan-2-ol (PubChem CID 93162213) has the molecular formula C23H32N2O2 and a molecular weight of 368.52 g/mol. Its IUPAC name is (2R)-1-[(3-methylphenyl)methyl-(2-morpholin-4-ylethyl)amino]-3-phenylpropan-2-ol.

Molecular Properties

Compound Name(2R)-1-[(3-methylphenyl)methyl-(2-morpholin-4-ylethyl)amino]-3-phenylpropan-2-ol
PubChem CID93162213
Molecular FormulaC23H32N2O2
Molecular Weight368.52 g/mol
Exact Mass368.25
IUPAC Name(2R)-1-[(3-methylphenyl)methyl-(2-morpholin-4-ylethyl)amino]-3-phenylpropan-2-ol
SMILESCc1cccc(CN(CCN2CCOCC2)C[C@H](O)Cc2ccccc2)c1
InChIInChI=1S/C23H32N2O2/c1-20-6-5-9-22(16-20)18-25(11-10-24-12-14-27-15-13-24)19-23(26)17-21-7-3-2-4-8-21/h2-9,16,23,26H,10-15,17-19H2,1H3/t23-/m1/s1
InChIKeyPYUYQKYFMACHSX-HSZRJFAPSA-N
XLogP2.73
TPSA35.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.52
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2R)-1-[(3-methylphenyl)methyl-(2-morpholin-4-ylethyl)amino]-3-phenylpropan-2-ol with MolForge

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Related Compounds

1-[(3-methylphenyl)methyl-(2-morpholin-4-ylethyl)amino]pentan-2-ol
CID 24714634
(2R)-1-[(3-methylphenyl)methyl-(2-morpholin-4-ylethyl)amino]-3-propan-2-yloxypropan-2-ol
CID 93162210
(2S)-1-(4-methoxyphenoxy)-3-[(3-methylphenyl)methyl-(2-morpholin-4-ylethyl)amino]propan-2-ol
CID 93162217
(2S)-1-[3-methylbutyl-[(3-methylphenyl)methyl]amino]-3-phenylpropan-2-ol
CID 93163145
(2R)-1-[(4-methylphenyl)methyl-(2-morpholin-4-ylethyl)amino]-3-phenoxypropan-2-ol
CID 93163691
1-[(3,4-dimethoxyphenyl)methyl-(2-morpholin-4-ylethyl)amino]-3-phenoxypropan-2-ol
CID 46006818
3-benzyl-1-[(3-methylphenyl)methyl]-1-(2-morpholin-4-ylethyl)urea
CID 110670133
(2S)-1-[benzyl(2-morpholin-4-ylethyl)amino]-3-(furan-2-ylmethoxy)propan-2-ol
CID 93161388
(2S)-1-[(3-methylphenyl)methyl-propan-2-ylamino]-3-phenylpropan-2-ol
CID 93162276
(2R)-1-[(4-fluorophenyl)methyl-(2-morpholin-4-ylethyl)amino]-3-(2-methylphenoxy)propan-2-ol
CID 93164054
1-[cyclopropyl-[(3-methylphenyl)methyl]amino]-3-phenylpropan-2-ol
CID 42837050
N-[(3-methylphenyl)methyl]-N-(2-morpholin-4-ylethyl)furan-2-carboxamide
CID 110670105

Frequently Asked Questions

What is the IUPAC name of (2R)-1-[(3-methylphenyl)methyl-(2-morpholin-4-ylethyl)amino]-3-phenylpropan-2-ol?
The IUPAC name of (2R)-1-[(3-methylphenyl)methyl-(2-morpholin-4-ylethyl)amino]-3-phenylpropan-2-ol (CID 93162213) is (2R)-1-[(3-methylphenyl)methyl-(2-morpholin-4-ylethyl)amino]-3-phenylpropan-2-ol.
What is the SMILES notation for (2R)-1-[(3-methylphenyl)methyl-(2-morpholin-4-ylethyl)amino]-3-phenylpropan-2-ol?
The canonical SMILES for (2R)-1-[(3-methylphenyl)methyl-(2-morpholin-4-ylethyl)amino]-3-phenylpropan-2-ol is Cc1cccc(CN(CCN2CCOCC2)C[C@H](O)Cc2ccccc2)c1.
What is the InChIKey of (2R)-1-[(3-methylphenyl)methyl-(2-morpholin-4-ylethyl)amino]-3-phenylpropan-2-ol?
The InChIKey is PYUYQKYFMACHSX-HSZRJFAPSA-N. The full InChI is InChI=1S/C23H32N2O2/c1-20-6-5-9-22(16-20)18-25(11-10-24-12-14-27-15-13-24)19-23(26)17-21-7-3-2-4-8-21/h2-9,16,23,26H,10-15,17-19H2,1H3/t23-/m1/s1.
What are the key properties of (2R)-1-[(3-methylphenyl)methyl-(2-morpholin-4-ylethyl)amino]-3-phenylpropan-2-ol?
(2R)-1-[(3-methylphenyl)methyl-(2-morpholin-4-ylethyl)amino]-3-phenylpropan-2-ol has a molecular weight of 368.52 g/mol, XLogP of 2.73, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[(3-methylphenyl)methyl-(2-morpholin-4-ylethyl)amino]-3-phenylpropan-2-ol is sourced from PubChem (CID 93162213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).